N-(4-Methylbenzyl)-2-(5-Nitro-1H-Indol-3-Yl)-2-Oxoacetamide

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Properties Simple | Detailed

Formula C18H15N3O4
IUPAC Name 2-(5-nitroindol-1-ium-3-yl)-2-oxo-n-(p-tolylmethyl)acetamide
Molecular Mass 337.329 g·mol−1
Heat of Formation -98.1 ± 16.7 kJ·mol−1
Dipole Moment 7.15 ± 1.08 D
Volume 379.04 Å 3
Surface Area 349.25 Å 2
HOMO Energy -9.51 ± 0.55 eV
LUMO Energy -1.40 ± eV
Point Group Symmetry C1
Synonyms
  • 2-keto-n-(4-methylbenzyl)-2-(5-nitro-1h-indol-3-yl)acetamide
  • n-[(4-methylphenyl)methyl]-2-(5-nitro-1h-indol-3-yl)-2-oxo-ethanamide
InChIKey CXKKDMBQHWZSKG-UHFFFAOYSA-N
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